Ethanol → HCID 86747326, compound

HRID 1219223Notes

Reaction equation

HRID 1219223 reaction equation
[C:20]([CH2:21][SH:22])(=[O:23])[O:24][CH2:25][CH3:26].[CH2:18]=[O:19].[CH3:27][CH2:28][OH:29].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][N:9]2[C:10](=[CH:14][N+:15](=[O:16])[O-:17])[NH:11][CH2:12][CH2:13]2)[cH:6][n:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][N:9]2[C:10](=[C:14]([N+:15](=[O:16])[O-:17])[CH2:18][S:22][CH2:21][C:20](=[O:23])[O:24][CH2:25][CH3:26])[NH:11][CH2:12][CH2:13]2)[cH:6][n:7]1

Participants

5

Reactant 4

HCID 702EthanolHCID 712FormaldehydeHCID 12185Ethyl ThioglycolateHCID 1809572-Chloro-5-{[2-(nitromethylidene)imidazolidin-1-yl]methyl}pyridine

Product 1

HCID 86747326HCID 86747326, compound

Sources & evidence

ORD record
ord-6b1f3366c44440009218030f0835b8cb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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